Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 11/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 11/20 | 0.49 |
| ▸ | COMT | P21964 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.41 |
| ▸ | DRD4 | P21917 | 3/20 | 0.41 |
| ▸ | DRD3 | P35462 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.39 |
| ▸ | TNK1 | Q13470 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13627486 | 0.91 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1DRD2DRD4DRD3 | |
| SCHEMBL13627483 | 0.89 | HSP90AA1 (0.53) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627491 | 0.86 | HSP90AA1 (0.65) | HSP90AA1HSP90AB1DRD2DRD4DRD3 | |
| SCHEMBL13627494 | 0.85 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1COMT | |
| SCHEMBL13627473 | 0.84 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627503 | 0.84 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627489 | 0.83 | HSP90AA1 (0.47) | HSP90AA1HSP90AB1COMTDRD2DRD4 | |
| SCHEMBL13627505 | 0.83 | HSP90AA1 (0.48) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627519 | 0.83 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1 | |
| SCHEMBL13627468 | 0.83 | HSP90AA1 (0.63) | HSP90AA1HSP90AB1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7612201-B2 | Pyrazole compounds | VERNALIS (CAMBRIDGE) LIMITED (GB) | 2009-11-03 | — | — | US | disclosed |
| US-7612201-B2 | Pyrazole compounds | VERNALIS (CAMBRIDGE) LIMITED (GB) | 2009-11-03 | — | — | US | disclosed |